6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine

C8H10BrN3O — CID 536282

IUPAC6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine
SMILESCc1nc(N)nc2c1CC(CBr)O2
InChIInChI=1S/C8H10BrN3O/c1-4-6-2-5(3-9)13-7(6)12-8(10)11-4/h5H,2-3H2,1H3,(H2,10,11,12)
InChIKeyZYOFSORYWFMTTC-UHFFFAOYSA-N
MW244.09 g/mol
LogP1.07
Rot. Bonds1

About 6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine

6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine (PubChem CID 536282) has the molecular formula C8H10BrN3O and a molecular weight of 244.09 g/mol. Its IUPAC name is 6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine
PubChem CID536282
Molecular FormulaC8H10BrN3O
Molecular Weight244.09 g/mol
Exact Mass243.00
IUPAC Name6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine
SMILESCc1nc(N)nc2c1CC(CBr)O2
InChIInChI=1S/C8H10BrN3O/c1-4-6-2-5(3-9)13-7(6)12-8(10)11-4/h5H,2-3H2,1H3,(H2,10,11,12)
InChIKeyZYOFSORYWFMTTC-UHFFFAOYSA-N
XLogP1.07
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.09
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

3-[(2-amino-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)oxy]-2,2-dimethylpropan-1-ol
CID 122536483
2-Methoxy-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidine
CID 46885007
6-(Bromomethyl)-4-methyl-2-methylsulfanyl-5,6-dihydrofuro[2,3-d]pyrimidine
CID 3100221
2-fluoro-7,7-dimethyl-4-propan-2-yloxy-5H-furo[3,4-d]pyrimidine
CID 172576532
5-fluoro-2,4,5-trimethyl-6H-furo[2,3-d]pyrimidine
CID 176758446
5-Fluoro-2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidine
CID 177024349
4-Methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine
CID 4098832
4-Methyl-5-propyl-6-(2,2,2-trifluoroethoxy)pyrimidin-2-amine
CID 1383248
4-(Trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine
CID 82396428
4-Methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-yl carbamimidothioate--hydrogen bromide (1/1)
CID 12739191
4-Methoxy-6,7-dihydro-5h-cyclopenta[d]pyrimidin-2-amine
CID 230744
4-Methyl-2-methylsulfanyl-5,6-dihydrofuro[2,3-d]pyrimidine
CID 10845150

Frequently Asked Questions

What is the IUPAC name of 6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine (CID 536282) is 6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine is Cc1nc(N)nc2c1CC(CBr)O2.
What is the InChIKey of 6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine?
The InChIKey is ZYOFSORYWFMTTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrN3O/c1-4-6-2-5(3-9)13-7(6)12-8(10)11-4/h5H,2-3H2,1H3,(H2,10,11,12).
What are the key properties of 6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine?
6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine has a molecular weight of 244.09 g/mol, XLogP of 1.07, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(bromomethyl)-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 536282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).